[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl]-methyl-(3-thienylmethyl)ammonium CAS Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [2-(1-adamantylmethylamino)-2-keto-ethyl]-methyl-(3-thenyl)ammonium Formula: C19H29N2OS+ MolecularWeight: 333.51136

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+](CC1=CSC=C1)CC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H28N2OS/c1-21(10-14-2-3-23-12-14)11-18(22)20-13-19-7-15-4-16(8-19)6-17(5-15)9-19/h2-3,12,15-17H,4-11,13H2,1H3,(H,20,22)/p+1